CHEBI:135645 - delmadinone acetate

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ChEBI Name delmadinone acetate
ChEBI ID CHEBI:135645
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H27ClO4
Net Charge 0
Average Mass 402.912
Monoisotopic Mass 402.160
InChI InChI=1S/C23H27ClO4/c1-13(25)23(28-14(2)26)10-7-18-16-12-20(24)19-11-15(27)5-8-21(19,3)17(16)6-9-22(18,23)4/h5,8,11-12,16-18H,6-7,9-10H2,1-4H3/t16-,17+,18+,21-,22+,23+/m1/s1
InChIKey CGBCCZZJVKUAMX-DFXBJWIESA-N
SMILES O(C(C)=O)[C@@]1(C(C)=O)[C@]2(C)[C@@](CC1)([C@]3([C@](CC2)([C@]4(C)C(C(=C3)Cl)=CC(C=C4)=O)[H])[H])[H]
Roles Classification
Biological Role(s): hormone
Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds.
(via steroid hormone )
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ChEBI Ontology
Outgoing delmadinone acetate (CHEBI:135645) is a corticosteroid hormone (CHEBI:36699)
Synonym Source
zenadrex DrugCentral
Manual Xref Database
3130 DrugCentral
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Registry Number Type Source
13698-49-2 CAS Registry Number DrugCentral
Last Modified
23 February 2017